Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.44 |
| ▸ | IRAK4 | Q9NWZ3 | 9/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.42 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.42 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.42 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.42 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.42 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.42 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.42 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.42 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.42 |
| ▸ | CACNG7 | P62955 | 1/20 | 0.42 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.42 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.42 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.42 |
| ▸ | CACNG1 | Q06432 | 1/20 | 0.42 |
| ▸ | CACNB2 | Q08289 | 1/20 | 0.42 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.42 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28452368 | 0.93 | IRAK4 (0.43) | GPR119IRAK4ALDH1A1LMNADNMT3A | |
| SCHEMBL28460224 | 0.91 | CACNB4 (0.41) | IRAK4ALDH1A1LMNADNMT3ACACNB4 | |
| SCHEMBL28455484 | 0.90 | APLNR (0.42) | ALDH1A1LMNAFGFR3KDR | |
| SCHEMBL28449757 | 0.85 | EGFR (0.44) | IRAK4FGFR4 | |
| SCHEMBL28898155 | 0.85 | JAK2 (0.45) | GPR119ALDH1A1JAK2JAK3PTK2 | |
| SCHEMBL28898962 | 0.84 | CACNB4 (0.41) | IRAK4ALDH1A1LMNADNMT3ACACNB4 | |
| SCHEMBL28456326 | 0.84 | APLNR (0.42) | ALDH1A1LMNAFGFR3KDR | |
| SCHEMBL28457706 | 0.82 | GPR119 (0.42) | GPR119ALDH1A1LMNADNMT3ACACNB4 | |
| SCHEMBL25204156 | 0.79 | GPR119 (0.44) | GPR119TTKJAK2JAK3PTK2 | |
| SCHEMBL28450193 | 0.78 | BTK (0.42) | FGFR1FGFR2FGFR4FGFR3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111662232-B | Small molecule compound with 2H-indazole structure and synthesis and application thereof | 中国科学院上海药物研究所 | 2022-08-02 | — | — | CN | disclosed |
| CN-111662232-A | Small molecule compound with 2H-indazole structure and synthesis and application thereof | 中国科学院上海药物研究所 | 2020-09-15 | — | — | CN | disclosed |